Ki Summary BindingDB logo
myBDB logout
Reaction Details
Report a problem with these data
TargetNAD(P)H dehydrogenase [quinone] 1
LigandBDBM50195864
Substrate/Competitorn/a
Meas. Tech.ChEMBL_425055 (CHEMBL911952)
IC50 22500±n/a nM
Citation Nolan, KATimson, DJStratford, IJBryce, RA In silico identification and biochemical characterization of novel inhibitors of NQO1. Bioorg Med Chem Lett16:6246-54 (2006) [PubMed]  Article
More Info.:Get all data from this article,  Assay Method
 
NAD(P)H dehydrogenase [quinone] 1
Name:NAD(P)H dehydrogenase [quinone] 1
Synonyms:Azoreductase | DIA4 | DT-diaphorase | Menadione reductase | NAD(P)H:quinone oxidoreductase 1 | NMOR1 | NQO1 | NQO1_HUMAN | Phylloquinone reductase | QR1 | Quinone Reductase 1 | Quinone reductase 1)
Type:Homodimer
Mol. Mass.:30874.82
Organism:Homo sapiens (Human)
Description:n/a
Residue:274
Sequence:
MVGRRALIVLAHSERTSFNYAMKEAAAAALKKKGWEVVESDLYAMNFNPIISRKDITGKL
KDPANFQYPAESVLAYKEGHLSPDIVAEQKKLEAADLVIFQFPLQWFGVPAILKGWFERV
FIGEFAYTYAAMYDKGPFRSKKAVLSITTGGSGSMYSLQGIHGDMNVILWPIQSGILHFC
GFQVLEPQLTYSIGHTPADARIQILEGWKKRLENIWDETPLYFAPSSLFDLNFQAGFLMK
KEVQDEEKNKKFGLSVGHHLGKSIPTDNQIKARK
Blast this sequence in BindingDB or PDB
  Blast E-value cutoff:
BDBM50195864
n/a
NameBDBM50195864
Synonyms:CHEMBL223702 | NSC-25415
TypeSmall organic molecule
Emp. Form.C11H8N2O
Mol. Mass.184.194
SMILESCOc1ccc2nc(ccc2c1)C#N
Structure
Search PDB for entries with ligand similarity:Similarity to this molecule at least: